The Augmented Spherical Wave Method A Comprehensive Treatment /

The Augmented Spherical Wave (ASW) method is one of the most powerful approaches for handling the requirements of finite basis sets in DFT calculations. While it is particularly suited for the calculation of the electronic, magnetic, and optical properties of solid-state materials, recent developmen...

Πλήρης περιγραφή

Λεπτομέρειες βιβλιογραφικής εγγραφής
Κύριος συγγραφέας: Eyert, Volker (Συγγραφέας)
Συγγραφή απο Οργανισμό/Αρχή: SpringerLink (Online service)
Μορφή: Ηλεκτρονική πηγή Ηλ. βιβλίο
Γλώσσα:English
Έκδοση: Berlin, Heidelberg : Springer Berlin Heidelberg, 2007.
Σειρά:Lecture Notes in Physics, 719
Θέματα:
Διαθέσιμο Online:Full Text via HEAL-Link
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490 1 |a Lecture Notes in Physics,  |x 0075-8450 ;  |v 719 
505 0 |a Introduction -- The Standard ASW Method -- Envelope Functions and Structure Constants -- The Plane-Wave Based Full-Potential ASW Method -- Details of the Standard ASW Method -- Details of the Envelope Functions -- Details of the Plane-Wave Based Full-Potential ASW Method -- Brillouin Integration -- Index. 
520 |a The Augmented Spherical Wave (ASW) method is one of the most powerful approaches for handling the requirements of finite basis sets in DFT calculations. While it is particularly suited for the calculation of the electronic, magnetic, and optical properties of solid-state materials, recent developments allow application, in addition, to the elastic properties and phonon spectra. The book addresses all those who want to learn about methods for electronic structure calculations and the ASW method, in particular. 
650 0 |a Physics. 
650 0 |a Chemistry, Physical and theoretical. 
650 0 |a Condensed matter. 
650 1 4 |a Physics. 
650 2 4 |a Condensed Matter Physics. 
650 2 4 |a Numerical and Computational Physics. 
650 2 4 |a Theoretical and Computational Chemistry. 
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776 0 8 |i Printed edition:  |z 9783540710066 
830 0 |a Lecture Notes in Physics,  |x 0075-8450 ;  |v 719 
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